4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-2-prop-2-enylsulfanyl-1,3-thiazol-5-one

Systemtic Name: 4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-2-prop-2-enylsulfanyl-1,3-thiazol-5-one Openeye Name: 2-allylsulfanyl-4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]thiazol-5-one CAS Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-(prop-2-enylthio)-5-thiazolone IUPAC Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-prop-2-enylsulfanyl-1,3-thiazol-5-one Traditional Name: 2-(allylthio)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-2-thiazolin-5-one Formula: C14H10BrNO3S2 MolecularWeight: 384.2681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC(=CC2=CC3=C(C=C2Br)OCO3)C(=O)S1

Isomeric SMILES

C=CCSC1=NC(=CC2=CC3=C(C=C2Br)OCO3)C(=O)S1

InChI

InChI=1S/C14H10BrNO3S2/c1-2-3-20-14-16-10(13(17)21-14)4-8-5-11-12(6-9(8)15)19-7-18-11/h2,4-6H,1,3,7H2